| SpectraBase Compound ID | 4s4rSruhIDK |
|---|---|
| InChI | InChI=1S/C44H53N5O10/c1-56-40(51)22-21-34-26-46-38(35(34)25-41(52)57-2)27-45-23-13-12-20-36(48-39(50)28-47-44(55)59-30-33-18-10-5-11-19-33)42(53)49-37(24-31-14-6-3-7-15-31)43(54)58-29-32-16-8-4-9-17-32/h3-11,14-19,26,36-37,45-46H,12-13,20-25,27-30H2,1-2H3,(H,47,55)(H,48,50)(H,49,53) |
| InChIKey | ARENIHCUVKJGJC-UHFFFAOYSA-N |
| Mol Weight | 811.9 g/mol |
| Molecular Formula | C44H53N5O10 |
| Exact Mass | 811.379243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KVpPwbBLmsp |
|---|---|
| Name | N-Benzyloxycarbonylglycyl-E-N-(4-<2-meo-carbonyl-et>-3-meo-carbonylmethylpyrrol-2-ylmethyl)-L-lysyl-L-phe benzyl ester |
| Comments | PHENYL CH PEAKS AT 127.0-129.3 PPM |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C44H53N5O10 |
| InChI | InChI=1S/C44H53N5O10/c1-56-40(51)22-21-34-26-46-38(35(34)25-41(52)57-2)27-45-23-13-12-20-36(48-39(50)28-47-44(55)59-30-33-18-10-5-11-19-33)42(53)49-37(24-31-14-6-3-7-15-31)43(54)58-29-32-16-8-4-9-17-32/h3-11,14-19,26,36-37,45-46H,12-13,20-25,27-30H2,1-2H3,(H,47,55)(H,48,50)(H,49,53) |
| InChIKey | ARENIHCUVKJGJC-UHFFFAOYSA-N |
| Instrument Name | Bruker WM-250 |
| Literature Reference | A.D. Miller, F.J. Leeper, A.R. Battersby, J. Chem. Soc. Perkin I 1943 (1989). |
| NMR Standard | CDCl3 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |